%chk=000080591.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080591

0 1
 S   2.5800001E-02   1.048900      8.9999998E-04
 O   -3.473800     -0.7468000     -4.3000001E-03
 O   -2.988500       1.473900      1.3000000E-03
 O    3.497900     -0.6442000      8.9999998E-04
 O    2.887400       1.464400     -2.0000001E-03
 N    2.591800      0.2361000     -6.0000003E-04
 C   -1.214600     -0.1315000      2.7999999E-03
 C    1.244700     -0.1540000     -1.1000000E-03
 C  -0.7090000      -1.412800      1.9000000E-03
 C   0.7158000      -1.425900     -1.9999999E-04
 C   -2.577400      0.2919000      3.9999999E-04
 H   -1.319400      -2.307200      2.0999999E-03
 H    1.311000      -2.330700     -7.9999998E-04
 H   -4.400400     -0.4246000     -6.3000000E-03


%chk=000080591-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080591

0 1
S 0.027982 1.179462 -0.000308
O -3.498694 -0.809963 -0.001539
O -3.068756 1.485416 -0.000938
O 3.514457 -0.767991 0.000553
O 2.981962 1.466626 0.000089
N 2.668841 0.209819 0.000241
C -1.236053 -0.103307 -0.000316
C 1.259456 -0.127450 0.000071
C -0.702314 -1.394578 -0.000268
C 0.725894 -1.413752 0.000068
C -2.649248 0.303934 -0.000290
H -1.336603 -2.282576 -0.000348
H 1.347863 -2.310009 0.000257
H -4.443487 -0.498132 -0.002273


